SCHEMBL17739747

SCHEMBL17739747

Bc1nnc(C(C)(C)C)o1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2616439 0.70
SCHEMBL15331235 0.69
SCHEMBL11007320 0.68
SCHEMBL21339904 0.68 CYP1A2 (0.30) CYP1A2
SCHEMBL19086947 0.68
SCHEMBL6123491 0.68
SCHEMBL10202700 0.68 EPHX2 (0.38) CYP1A2
SCHEMBL22545669 0.68
SCHEMBL19287685 0.68
SCHEMBL3858280 0.64 RAB9A (0.61)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016071360-A1 HERBICIDAL PYRROLONE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-05-12 WO disclosed
WO-2016071364-A2 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-05-12 WO disclosed
WO-2016071359-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-05-12 WO disclosed